3-Biphenylacetic acid, 5-isobutoxy-
TL;DR: 3-Biphenylacetic acid, 5-isobutoxy- (CAS 61888-58-2) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2-methylpropoxy)-5-phenylphenyl]acetic acid
Also Known As: 5-Isobutoxy-3-biphenylacetic acid, 5-Isobutoxy-3-biphenylaceticacid, 3-BIPHENYLACETIC ACID, 5-ISOBUTOXY-, 2-[3-(2-methylpropoxy)-5-phenylphenyl]acetic acid, [1,1'-Biphenyl]-3-acetic acid, 5-(2-methylpropoxy)-
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 61888-58-2 |
|---|---|
| SMILES | CC(C)COC1=CC(=CC(=C1)C2=CC=CC=C2)CC(=O)O |
| InChIKey | UEEUXNYHDGTSTK-UHFFFAOYSA-N |
Product Overview
3-Biphenylacetic acid, 5-isobutoxy- (CAS 61888-58-2), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: 2-[3-(2-methylpropoxy)-5-phenylphenyl]acetic acid.
Chemical Property Profile of 3-Biphenylacetic acid, 5-isobutoxy-
Property Insights of 3-Biphenylacetic acid, 5-isobutoxy-
The XLogP value of 4.3 indicates that 3-Biphenylacetic acid, 5-isobutoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3-Biphenylacetic acid, 5-isobutoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Biphenylacetic acid, 5-isobutoxy- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Biphenylacetic acid, 5-isobutoxy-?
The CAS number of 3-Biphenylacetic acid, 5-isobutoxy- is 61888-58-2.
What is the molecular formula of 3-Biphenylacetic acid, 5-isobutoxy-?
The molecular formula of 3-Biphenylacetic acid, 5-isobutoxy- is C18H20O3.
What is the molecular weight of 3-Biphenylacetic acid, 5-isobutoxy-?
The molecular weight of 3-Biphenylacetic acid, 5-isobutoxy- is 284.14 g/mol.
Where can I buy 3-Biphenylacetic acid, 5-isobutoxy-?
You can request a quote for 3-Biphenylacetic acid, 5-isobutoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Biphenylacetic acid, 5-isobutoxy-?
Yes, KEHONG BIO provides custom synthesis services for 3-Biphenylacetic acid, 5-isobutoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.